Glycoside
GD128183
Name:
4-(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3,7-dioxabicyclo[4.1.0]heptan-2-oneFormula:
C17H20O9Smiles:
O=C1OC(c2ccc(OC3OC(CO)C(O)C(O)C3O)cc2)CC2OC12Aglycone:
O=C1OC(c2ccc(O)cc2)CC2OC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | -1.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 368.34 | Num_heavy_atoms: | 26 |
| TPSA: | 138.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD51927
Formula: C11H10O4
Smiles:
O=C1OC(c2ccc(O)cc2)CC2OC12| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 1.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 206.2 | Num_heavy_atoms: | 15 |
| TPSA: | 59.06 | NumAromaticRings: | 1 |
